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canSAR1157209
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NAMES
    SMILES
    CC[C@H]1CC[C@@H](Cc2ccc(Cl)cc2)[C@]1(O)Cn1cncn1
    InChI
    InChI=1S/C17H22ClN3O/c1-2-14-5-6-15(9-13-3-7-16(18)8-4-13)17(14,22)10-21-12-19-11-20-21/h3-4,7-8,11-12,14-15,22H,2,5-6,9-10H2,1H3/t14-,15-,17-/m0/s1
    MOLECULAR FORMULA
    C17H22ClN3O
    CROSS REFERENCES
    1157209 logo

    canSAR1157209

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 319.15
    AlogP 3.34
    HBond donors 1
    HBond acceptors 4
    Atoms 44
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1157209.